Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.64 |
| ▸ | USP2 | O75604 | 3/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3646966 | 1.00 | AR (0.64) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3652654 | 1.00 | AR (0.64) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL13269898 | 0.93 | USP2 (0.57) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3654931 | 0.93 | USP2 (0.57) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3652551 | 0.93 | USP2 (0.57) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3652555 | 0.93 | USP2 (0.57) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3701253 | 0.91 | HTT (0.69) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3649179 | 0.88 | AR (0.63) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3649185 | 0.88 | AR (0.63) | ARUSP2HTTNPSR1SMN1; SMN2 | |
| SCHEMBL3653615 | 0.88 | USP2 (0.51) | ARUSP2HTTNPSR1SMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2188266-A2 | NOVEL PIPERAZINE AMIDE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2010-05-26 | — | — | EP | claimed |
| WO-2009021868-A2 | NOVEL PIPERAZINE AMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2009-02-19 | — | — | WO | claimed |
| EP-2188266-A2 | NOVEL PIPERAZINE AMIDE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2010-05-26 | — | — | EP | disclosed |
| WO-2009021868-A2 | NOVEL PIPERAZINE AMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2009-02-19 | — | — | WO | disclosed |